HRID96226

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8028

Tetrahydrofuran

C4H8O

HCID16028

Tetrabutylammonium

C16H36N+

HCID28179

Fluoride

F-

结构：CCN(CC)CCOc1ccc(-c2cc3c(Oc4ccc(NC(=O)NC5CC5)c(F)c4)ncnc3n2COCC[Si](C)(C)C)cc1

HCID58930865

未命名化合物

PRODUCTS

生成物

结构：CCN(CC)CCOc1ccc(-c2cc3c(Oc4ccc(NC(=O)NC5CC5)c(F)c4)ncnc3[nH]2)cc1

HCID58930900

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-833a164673b243b78b65421eb3f83ebb
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (2/10)

反应 SMILES

[CH3:48][CH2:49][CH2:50][CH2:51][N+:52]([CH2:53][CH2:54][CH2:55][CH3:56])([CH2:57][CH2:58][CH2:59][CH3:60])[CH2:61][CH2:62][CH2:63][CH3:64].[CH:1]1([NH:4][C:5](=[O:6])[NH:7][c:8]2[c:9]([F:46])[cH:10][c:11]([O:14][c:15]3[c:16]4[c:17]([n:18][cH:19][n:20]3)[n:21]([CH2:38][O:39][CH2:40][CH2:41][Si:42]([CH3:43])([CH3:44])[CH3:45])[c:22](-[c:24]3[cH:25][cH:26][c:27]([O:30][CH2:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37])[cH:28][cH:29]3)[cH:23]4)[cH:12][cH:13]2)[CH2:2][CH2:3]1.[F-:47].[O:66]1[CH2:67][CH2:68][CH2:69][CH2:70]1.[OH2:65]>>[CH:1]1([NH:4][C:5](=[O:6])[NH:7][c:8]2[c:9]([F:46])[cH:10][c:11]([O:14][c:15]3[c:16]4[c:17]([n:18][cH:19][n:20]3)[nH:21][c:22](-[c:24]3[cH:25][cH:26][c:27]([O:30][CH2:31][CH2:32][N:33]([CH2:34][CH3:35])[CH2:36][CH3:37])[cH:28][cH:29]3)[cH:23]4)[cH:12][cH:13]2)[CH2:2][CH2:3]1